methyl 4-[3-(hydroxymethyl)-1-benzothiophen-5-yl]benzoate

Systemtic Name: methyl 4-[3-(hydroxymethyl)-1-benzothiophen-5-yl]benzoate Openeye Name: methyl 4-[3-(hydroxymethyl)benzothiophen-5-yl]benzoate CAS Name: 4-[3-(hydroxymethyl)-1-benzothiophen-5-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(hydroxymethyl)-1-benzothiophen-5-yl]benzoate Traditional Name: 4-(3-methylolbenzothiophen-5-yl)benzoic acid methyl ester Formula: C17H14O3S MolecularWeight: 298.35626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)SC=C3CO

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)SC=C3CO

InChI

InChI=1S/C17H14O3S/c1-20-17(19)12-4-2-11(3-5-12)13-6-7-16-15(8-13)14(9-18)10-21-16/h2-8,10,18H,9H2,1H3